Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

InChI	InChI=1S/C25H24N2O4/c1-16(22(28)26-23(29)17-9-4-3-5-10-17)25(18-11-8-12-19(15-18)31-2)21-14-7-6-13-20(21)24(30)27-25/h3-16,22,28H,1-2H3,(H,26,29)(H,27,30)/t16-,22?,25-/m0/s1
SMILES	COc1cccc(c1)[C@@]1(NC(=O)c2c1cccc2)[C@H](C(NC(=O)c1ccccc1)O)C
InChI Key	YEHMDQMIHWNOQU-DFALHLEKSA-N
Molecular Formula	C25H24N2O4
Exact Mass	416.469 g/mol

Data and Resources

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Metadata Information

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• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/YEHMDQMIHWNOQU-DFALHLEKSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/YEHMDQMIHWNOQU-DFALHLEKSA-N/CHMO0000595
Version
Author	Georg Manolikakes
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2025-01-29T10:30:39.134749
MetadataModified	2025-01-29T16:23:18.068596
MetadataPublished	2024-11-13

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables	Temperature : 296.3 K K Puls programme : zgpg30 Number of scans : 512 Title : MHA-r155_analyticc Date : 20231206 Start time : 12.58 Instrument : spect Label : MHA-436 ID : 107811 Solvent : DMSO

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.